Isopropyl octanoate

CAS Registry Number®

5458-59-3

CAS Name

Isopropyl octanoate

Molecular Formula

C11H22O2

Molecular Mass

186.29

Cite this Page

Isopropyl octanoate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=5458-59-3 (retrieved 2024-11-22) (CAS RN: 5458-59-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    242 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C11H22O2/c1-4-5-6-7-8-9-11(12)13-10(2)3/h10H,4-9H2,1-3H3

InChIKey

InChIKey=WCGIIHOFOFCKSM-UHFFFAOYSA-N

SMILES

C(C(OC(C)C)=O)CCCCCC

Canonical SMILES

O=C(OC(C)C)CCCCCCC

Other Names for this Substance

  • Octanoic acid, 1-methylethyl ester
  • Octanoic acid, isopropyl ester
  • Isopropyl octanoate
  • Isopropyl caprylate
  • NSC 23737

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CAS INSIGHTSTM
Targeted protein degrader structure, illustration